1-butylimidazo[4,5-c]quinoline-4-carboxamide

C15H16N4O — CID 25006952

IUPAC1-butylimidazo[4,5-c]quinoline-4-carboxamide
SMILESCCCCn1cnc2c(C(N)=O)nc3ccccc3c21
InChIInChI=1S/C15H16N4O/c1-2-3-8-19-9-17-12-13(15(16)20)18-11-7-5-4-6-10(11)14(12)19/h4-7,9H,2-3,8H2,1H3,(H2,16,20)
InChIKeyXCENCPJFYPNYBL-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.48
Rot. Bonds4

About 1-butylimidazo[4,5-c]quinoline-4-carboxamide

1-butylimidazo[4,5-c]quinoline-4-carboxamide (PubChem CID 25006952) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is 1-butylimidazo[4,5-c]quinoline-4-carboxamide.

Molecular Properties

Compound Name1-butylimidazo[4,5-c]quinoline-4-carboxamide
PubChem CID25006952
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Name1-butylimidazo[4,5-c]quinoline-4-carboxamide
SMILESCCCCn1cnc2c(C(N)=O)nc3ccccc3c21
InChIInChI=1S/C15H16N4O/c1-2-3-8-19-9-17-12-13(15(16)20)18-11-7-5-4-6-10(11)14(12)19/h4-7,9H,2-3,8H2,1H3,(H2,16,20)
InChIKeyXCENCPJFYPNYBL-UHFFFAOYSA-N
XLogP2.48
TPSA73.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Imiquimod
CID 57469
Alosetron
CID 2099
Alosetron Hydrochloride
CID 60758
4H-Imidazo(4,5-c)quinolin-4-one, 1,5-dihydro-5-butyl-1-methyl-
CID 3077017
IC 87114
CID 9908783
KF 18280
CID 3071941
10-[2-(Dimethylamino)ethylamino]-1,14-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaen-8-one
CID 438569
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-3-ethyl-5-phenyl-
CID 3071939
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-3-methyl-5-phenyl-
CID 3071959
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-5-phenyl-3-propyl-
CID 3071969
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-3-(2-methylpropyl)-5-phenyl-
CID 3071971
10-[2-(Diethylamino)ethylamino]-1,14-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaen-8-one
CID 371512

Frequently Asked Questions

What is the IUPAC name of 1-butylimidazo[4,5-c]quinoline-4-carboxamide?
The IUPAC name of 1-butylimidazo[4,5-c]quinoline-4-carboxamide (CID 25006952) is 1-butylimidazo[4,5-c]quinoline-4-carboxamide.
What is the SMILES notation for 1-butylimidazo[4,5-c]quinoline-4-carboxamide?
The canonical SMILES for 1-butylimidazo[4,5-c]quinoline-4-carboxamide is CCCCn1cnc2c(C(N)=O)nc3ccccc3c21.
What is the InChIKey of 1-butylimidazo[4,5-c]quinoline-4-carboxamide?
The InChIKey is XCENCPJFYPNYBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-2-3-8-19-9-17-12-13(15(16)20)18-11-7-5-4-6-10(11)14(12)19/h4-7,9H,2-3,8H2,1H3,(H2,16,20).
What are the key properties of 1-butylimidazo[4,5-c]quinoline-4-carboxamide?
1-butylimidazo[4,5-c]quinoline-4-carboxamide has a molecular weight of 268.32 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butylimidazo[4,5-c]quinoline-4-carboxamide is sourced from PubChem (CID 25006952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).